phenyl (7Z)-7-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-3-propan-2-ylsulfonyl-1H-imidazo[1,2-a]pyridine-5-sulfonate

Systemtic Name: phenyl (7Z)-7-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-3-propan-2-ylsulfonyl-1H-imidazo[1,2-a]pyridine-5-sulfonate Openeye Name: phenyl (7Z)-3-isopropylsulfonyl-7-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-imidazo[1,2-a]pyridine-5-sulfonate CAS Name: (7Z)-7-(6-oxo-1-cyclohexa-2,4-dienylidene)-3-propan-2-ylsulfonyl-1H-imidazo[1,2-a]pyridine-5-sulfonic acid phenyl ester IUPAC Name: phenyl (7Z)-7-(6-oxocyclohexa-2,4-dien-1-ylidene)-3-propan-2-ylsulfonyl-1H-imidazo[1,2-a]pyridine-5-sulfonate Traditional Name: (7Z)-3-isopropylsulfonyl-7-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-imidazo[1,2-a]pyridine-5-sulfonic acid phenyl ester Formula: C22H20N2O6S2 MolecularWeight: 472.534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CNC2=CC(=C3C=CC=CC3=O)C=C(N21)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CC(C)S(=O)(=O)C1=CNC2=C/C(=C/3\C=CC=CC3=O)/C=C(N21)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O6S2/c1-15(2)31(26,27)22-14-23-20-12-16(18-10-6-7-11-19(18)25)13-21(24(20)22)32(28,29)30-17-8-4-3-5-9-17/h3-15,23H,1-2H3/b18-16-